ChemSpider 2D Image | (3alpha,5beta)-3-Hydroxy-N-[3-(1,4,4-trimethyl-1-piperazinediiumyl)propyl]cholan-24-amide | C34H63N3O2

(3α,5β)-3-Hydroxy-N-[3-(1,4,4-trimethyl-1-piperazinediiumyl)propyl]cholan-24-amide

  • Molecular FormulaC34H63N3O2
  • Average mass545.882 Da
  • Monoisotopic mass545.490906 Da
  • ChemSpider ID8072880

  • Charge - Charge

    defined stereocentres - 9 of 9 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(3α,5β)-3-Hydroxy-N-[3-(1,4,4-trimethyl-1-piperazindiiumyl)propyl]cholan-24-amid [German] [ACD/IUPAC Name]
(3α,5β)-3-Hydroxy-N-[3-(1,4,4-trimethyl-1-piperazinediiumyl)propyl]cholan-24-amide [ACD/IUPAC Name]
(3α,5β)-3-Hydroxy-N-[3-(1,4,4-triméthyl-1-pipérazinediiumyl)propyl]cholan-24-amide [French] [ACD/IUPAC Name]
Cholan-24-amide, 3-hydroxy-N-[3-(1,4,4-trimethyl-1-piperaziniumyl)propyl]-, (3α,5β)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 3.40
ACD/LogD (pH 5.5): -2.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.76
ACD/LogD (pH 7.4): -2.08
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.76
Polar Surface Area: 49 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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